(2E,3Z)-2-ethylidene-1,5-dimethyl-3-propylidenepyrrole

C11H17N — CID 89003616

IUPAC(2E,3Z)-2-ethylidene-1,5-dimethyl-3-propylidenepyrrole
SMILESC/C=c1\c(=C/CC)cc(C)n1C
InChIInChI=1S/C11H17N/c1-5-7-10-8-9(3)12(4)11(10)6-2/h6-8H,5H2,1-4H3/b10-7-,11-6+
InChIKeyUPFWJWGQCAMJDB-IKVLVDHLSA-N
MW163.26 g/mol
LogP1.32
Rot. Bonds1

About (2E,3Z)-2-ethylidene-1,5-dimethyl-3-propylidenepyrrole

(2E,3Z)-2-ethylidene-1,5-dimethyl-3-propylidenepyrrole (PubChem CID 89003616) has the molecular formula C11H17N and a molecular weight of 163.26 g/mol. Its IUPAC name is (2E,3Z)-2-ethylidene-1,5-dimethyl-3-propylidenepyrrole.

Molecular Properties

Compound Name(2E,3Z)-2-ethylidene-1,5-dimethyl-3-propylidenepyrrole
PubChem CID89003616
Molecular FormulaC11H17N
Molecular Weight163.26 g/mol
Exact Mass163.14
IUPAC Name(2E,3Z)-2-ethylidene-1,5-dimethyl-3-propylidenepyrrole
SMILESC/C=c1\c(=C/CC)cc(C)n1C
InChIInChI=1S/C11H17N/c1-5-7-10-8-9(3)12(4)11(10)6-2/h6-8H,5H2,1-4H3/b10-7-,11-6+
InChIKeyUPFWJWGQCAMJDB-IKVLVDHLSA-N
XLogP1.32
TPSA4.93 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500163.26
LogP ≤ 51.32
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

Magnesidin
CID 139589189
Ethanamine, 1-(2,4-cyclopentadien-1-ylidene)-N,N-dimethyl-
CID 585126
Dimethylaminofulvene
CID 90007951
(3Z,5E,8Z)-5-fluoro-1,8-dimethyl-2-methylidene-1-azacycloundeca-3,5,8-triene
CID 89299112
2-Ethyl-1,1,5-trimethyl-3-(trifluoromethyl)pyrrol-1-ium
CID 123139499
3-fluoro-1-[(3E)-5-methylhexa-1,3,5-trien-3-yl]pyrrolidine
CID 144746560
(2E,3E)-3-(1-fluoroethylidene)-1,5-dimethyl-2-propylidenepyrrole
CID 144831865
3-(fluoromethyl)-1,2-dimethyl-5-methylidene-2H-pyrrole
CID 146290476
(3E,4E)-N-fluoro-N,5-dimethyl-3-propylidenehepta-1,4-dien-2-amine
CID 155001788
N-[1-(4-fluorocyclobuta-1,3-dien-1-yl)ethenyl]-N,3-dimethylbut-1-en-2-amine
CID 164023493
(2E,3Z)-3-ethylidene-2-(2-fluoroprop-2-enylidene)-1,5-dimethylpyrrole
CID 167047016
(2Z,4Z)-4-fluoro-N,N,5-trimethylhepta-2,4-dien-2-amine
CID 173817772

Frequently Asked Questions

What is the IUPAC name of (2E,3Z)-2-ethylidene-1,5-dimethyl-3-propylidenepyrrole?
The IUPAC name of (2E,3Z)-2-ethylidene-1,5-dimethyl-3-propylidenepyrrole (CID 89003616) is (2E,3Z)-2-ethylidene-1,5-dimethyl-3-propylidenepyrrole.
What is the SMILES notation for (2E,3Z)-2-ethylidene-1,5-dimethyl-3-propylidenepyrrole?
The canonical SMILES for (2E,3Z)-2-ethylidene-1,5-dimethyl-3-propylidenepyrrole is C/C=c1\c(=C/CC)cc(C)n1C.
What is the InChIKey of (2E,3Z)-2-ethylidene-1,5-dimethyl-3-propylidenepyrrole?
The InChIKey is UPFWJWGQCAMJDB-IKVLVDHLSA-N. The full InChI is InChI=1S/C11H17N/c1-5-7-10-8-9(3)12(4)11(10)6-2/h6-8H,5H2,1-4H3/b10-7-,11-6+.
What are the key properties of (2E,3Z)-2-ethylidene-1,5-dimethyl-3-propylidenepyrrole?
(2E,3Z)-2-ethylidene-1,5-dimethyl-3-propylidenepyrrole has a molecular weight of 163.26 g/mol, XLogP of 1.32, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (2E,3Z)-2-ethylidene-1,5-dimethyl-3-propylidenepyrrole is sourced from PubChem (CID 89003616), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).